6-(Methylthio)benzo[d][1,3]dioxol-5-amine

Base Information

Chemical Name:6-(Methylthio)benzo[d][1,3]dioxol-5-amine
CAS No.:68560-13-4
Molecular Formula:C₈H₉NO₂S
Molecular Weight:183.231
Hs Code.:2932999099
DSSTox Substance ID:DTXSID20507127
Wikidata:Q82363174
Mol file:68560-13-4.mol

Synonyms:6-(Methylthio)benzo[d][1,3]dioxol-5-amine;68560-13-4;5-Amino-6-(methylthio)benzo[d][1,3]dioxole;6-methylsulfanyl-1,3-benzodioxol-5-amine;SCHEMBL4141446;DTXSID20507127;AC8438;MFCD20701201;SY263344;6-(methylsulfanyl)-1,3-dioxaindan-5-amine;CS-0104523;6-(Methylsulfanyl)-2H-1,3-benzodioxol-5-amine;EN300-24500888

Suppliers and Price of 6-(Methylthio)benzo[d][1,3]dioxol-5-amine

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Crysdot
6-(Methylthio)benzo[d][1,3]dioxol-5-amine 95+%
1g
$ 535.00

Chemenu
6-(methylthio)benzo[d][1,3]dioxol-5-amine 95%
1g
$ 505.00

American Custom Chemicals Corporation
6-(METHYLTHIO)BENZO[D][1,3]DIOXOL-5-AMINE 95.00%
5MG
$ 501.19

Alichem
6-(Methylthio)benzo[d][1,3]dioxol-5-amine
1g
$ 470.88

AK Scientific
6-(Methylthio)benzo[d][1,3]dioxol-5-amine
1g
$ 1133.00

Total 7 raw suppliers

Chemical Property of 6-(Methylthio)benzo[d][1,3]dioxol-5-amine

Chemical Property:

Boiling Point:140-145 °C(Press: 3 Torr)
PKA:3.76±0.20(Predicted)
PSA：69.78000
Density:1.37±0.1 g/cm3(Predicted)
LogP:2.30060
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:183.03539970
Heavy Atom Count:12
Complexity:167

Purity/Quality:

99% ^*data from raw suppliers

6-(Methylthio)benzo[d][1,3]dioxol-5-amine 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CSC1=CC2=C(C=C1N)OCO2

Technology Process of 6-(Methylthio)benzo[d][1,3]dioxol-5-amine

There total 2 articles about 6-(Methylthio)benzo[d][1,3]dioxol-5-amine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 67.3%

: 68560-11-2
2-methylthio-4,5-methylenedioxynitrobenzene

: 68560-13-4
6-(methylthio)benzo[d][1,3]dioxol-5-amine

Guidance literature:: 2-methylthio-4,5-methylenedioxynitrobenzene; With hydrogenchloride; ethanol; water; iron; at 110 ℃; for 2h;

In ethanol; water; pH=11; Alkaline aqueous solution;

Reference yield:

: 7748-58-5
1-bromo-4,5-methylenedioxy-2-nitrobenzene

: 68560-13-4
6-(methylthio)benzo[d][1,3]dioxol-5-amine

Guidance literature:: Multi-step reaction with 2 steps

1: K₂CO₃ / ethanol / 24 h / Ambient temperature

2: Sn, conc. HCl / acetic acid / 1.5 h / 100 - 105 °C

With hydrogenchloride; tin; potassium carbonate; In ethanol; acetic acid;
DOI:10.1021/jm00181a003